Chem
J-GLOBAL ID：200907093465045602   Nikkaji number：J1.916.334B

Moverastin

モベラスチン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C23H32O5
Molecular formula furigana： C23-H32-O5
Molecular weight： 388.504
InChI： InChI=1S/C23H32O5/c1-13(8-9-23(5)15(3)6-7-19(25)16(23)4)20(26)11-18-21(27)14(2)10-17(12-24)22(18)28/h10,12,15-16,20,26-28H,1,6-9,11H2,2-5H3/t15-,16+,20?,23+/m1/s1
InChI key： WMWCXLLJPFZATQ-ZLCGBHAHSA-N
SMILES： C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CCC(=C)C(O)Cc1c(O)c(C)cc(C=O)c1O
Systematic name  (3)：
  • 2,4-ジヒドロキシ-3-[5-(1β,2β,6β-トリメチル-3-オキソシクロヘキシル)-2-ヒドロキシ-3-メチレンペンチル]-5-メチルベンズアルデヒド
  • 2,4-ジヒドロキシ-3-{2-ヒドロキシ-3-メチリデン-5-[(1S,2R,6R)-1,2,6-トリメチル-3-オキソシクロヘキシル]ペンチル}-5-メチルベンズアルデヒド
  • 2,4-dihydroxy-3-{2-hydroxy-3-methylidene-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pentyl}-5-methylbenzaldehyde
Other name (3)：
  • 2,4-Dihydroxy-3-[5-(1β,2β,6β-trimethyl-3-oxocyclohexyl)-2-hydroxy-3-methylenepentyl]-5-methylbenzaldehyde
  • モベラスチン
  • Moverastin
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